UCSF

ZINC33591040

Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2009 30 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.19 9.15 -14.59 1 6 0 46 450.004 10
Mid Mid (pH 6-8) 3.19 11.4 -66.84 2 6 1 47 451.012 10

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Analogs ( Draw Identity 99% 90% 80% 70% )